1-[2-(2-imidazol-1-ylethyl)piperidin-1-yl]-3-phenyl-butan-1-one

Systemtic Name: 1-[2-(2-imidazol-1-ylethyl)piperidin-1-yl]-3-phenyl-butan-1-one Openeye Name: 1-[2-(2-imidazol-1-ylethyl)-1-piperidyl]-3-phenyl-butan-1-one CAS Name: 1-[2-[2-(1-imidazolyl)ethyl]-1-piperidinyl]-3-phenyl-1-butanone IUPAC Name: 1-[2-(2-imidazol-1-ylethyl)piperidin-1-yl]-3-phenylbutan-1-one Traditional Name: 1-[2-(2-imidazol-1-ylethyl)piperidino]-3-phenyl-butan-1-one Formula: C20H27N3O MolecularWeight: 325.44788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCCCC1CCN2C=CN=C2)C3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)N1CCCCC1CCN2C=CN=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H27N3O/c1-17(18-7-3-2-4-8-18)15-20(24)23-12-6-5-9-19(23)10-13-22-14-11-21-16-22/h2-4,7-8,11,14,16-17,19H,5-6,9-10,12-13,15H2,1H3